Vitas-M small molecule compound
(5E)-5-{[2,5-dimethyl-1-(naphthalen-2-yl)-1H-pyrrol-3-yl]methylidene}-1-(prop-2-en-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK188252
SMILES C=CCN1C(=S)NC(=O)/C(=C\c2cc(n(c2C)c2ccc3c(c2)cccc3)C)/C1=O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C24H21N3O2S MW 415.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O2S/c1-4-11-26-23(29)21(22(28)25-24(26)30)14-19-12-15(2)27(16(19)3)20-10-9-17-7-5-6-8-18(17)13-20/h4-10,12-14H,1,11H2,2-3H3,(H,25,28,30)/b21-14+InChIKey
VWNWRJDAKSUPLU-KGENOOAVSA-NSynonyms
(5E)5((25DIMETHYL1(NAPHTHALEN2YL)1HPYRROL3YL)METHYLIDENE)1(PROP2EN1YL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5E)5((25DIMETHYL1NAPHTHALEN2YLPYRROL3YL)METHYLIDENE)1PROP2ENYL2SULFANYLIDENE13DIAZINANE46DIONE
C=CCN1C(=S)NC(=O)C(=Cc2cc(n(c2C)c2ccc3c(c2)cccc3)C)C1=O
CC1=CC(=C(N1C2=CC3=CC=CC=C3C=C2)C)C=C4C(=O)NC(=S)N(C4=O)CC=C
InChI=1SC24H21N3O2Sc14112623(29)21(22(28)2524(26)30)14191215(2)27(16(19)3)2010917756818(17)1320h4101214H111H223H3(H252830)b2114+
MFCD03247804
ZINC000004711437
ZINC04711437
ZINC4711437
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